SCHEMBL8736459

SCHEMBL8736459

N#Cc1ccc(CCOCc2ccc3ccc(OCc4ccc5ccccc5n4)cc3c2)cc1

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 11/20 0.71
FFAR1 O14842 1/20 0.51
AKR1B1 P15121 1/20 0.51
CYSLTR2 Q9NS75 5/20 0.49
PDE10A Q9Y233 1/20 0.48
GPBAR1 Q8TDU6 1/20 0.47
ALOX5AP P20292 2/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8733767 0.91 CYSLTR1 (0.71) CYSLTR1FFAR1AKR1B1CYSLTR2PDE10A
SCHEMBL8736043 0.89 CYSLTR1 (0.60) CYSLTR1FFAR1AKR1B1CYSLTR2PDE10A
SCHEMBL8732371 0.86 CYSLTR1 (0.57) CYSLTR1FFAR1AKR1B1CYSLTR2PDE10A
SCHEMBL9828564 0.85 CYSLTR1 (0.65) CYSLTR1FFAR1AKR1B1CYSLTR2PDE10A
SCHEMBL8732501 0.84 CYSLTR1 (0.52) CYSLTR1FFAR1AKR1B1CYSLTR2PDE10A
SCHEMBL8732535 0.83 CYSLTR1 (1.00) CYSLTR1FFAR1AKR1B1GPBAR1
SCHEMBL7808312 0.81 CYSLTR1 (0.64) CYSLTR1FFAR1AKR1B1CYSLTR2PDE10A
SCHEMBL10607508 0.81 CYSLTR1 (0.71) CYSLTR1FFAR1AKR1B1CYSLTR2PDE10A
SCHEMBL8733768 0.80 CYSLTR1 (1.00) CYSLTR1CYSLTR2GPBAR1
SCHEMBL7007566 0.80 CYSLTR1 (0.62) CYSLTR1CYSLTR2GPBAR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0874826-A1 NAPHTHALENE QUINOLINES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1998-11-04 EP disclosed
WO-1997024331-A1 NAPHTHALENE QUINOLINES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1997-07-10 WO disclosed